Electrostatic potential around a charged sphere with cation binding
β Scribed by Joe Bentz
- Publisher
- Elsevier Science
- Year
- 1981
- Tongue
- English
- Weight
- 882 KB
- Volume
- 80
- Category
- Article
- ISSN
- 0021-9797
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π SIMILAR VOLUMES
The long-range electrostatic interaction between a pair of similarly charged colloidal spheres and a charged planar wall at low surface potentials is theoretically investigated. The linear Poisson-Boltzmann equation (PBE) and the point charge approximation of the charged sphere are used. The electri
Electrostatic potentials calculated from AM1 wave functions have been compared with ab initio STO-3G values and qualitative agreement has been found. Atomic charges derived from AM1 electrostatic potentials for both experimental and AM1 optimized geometries are of comparable quality with STO-3G pote
It is shown that the effect of the binding of an alkali and alkaline-earth cation on the properties of a molecule may be evaluated by replacing the cation by an appropriate pcint charge. The procedure is utilized to evaluate the effect of a monoor divalent ion placed in different positions on the mo